1,3-Propanediol dipalmitate
TL;DR: 1,3-Propanediol dipalmitate (CAS 818-21-3) is a chemical compound with molecular formula C35H68O4 and molecular weight 552.51 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-hexadecanoyloxypropyl hexadecanoate
Also Known As: Palmitic acid, trimethylene ester, 1,3-Propanediol dipalmitate, 1,3-Propanediyl dipalmitate, 1,3-Propanediol, dipalmitate, Hexadecanoic acid, 1,3-propanediyl ester
| Molecular Formula | C35H68O4 |
|---|---|
| Molecular Weight | 552.51 g/mol |
| LogP | 15.0 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 34 |
| Exact Mass | 552.5118 |
| Heavy Atoms | 39 |
| Complexity | 461.0 |
Chemical Identifiers
| CAS Number | 818-21-3 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCC(=O)OCCCOC(=O)CCCCCCCCCCCCCCC |
| InChIKey | FBFGIPIHQQUDQF-UHFFFAOYSA-N |
Product Overview
1,3-Propanediol dipalmitate (CAS 818-21-3), with molecular formula C35H68O4 and molecular weight 552.51 g/mol. IUPAC: 3-hexadecanoyloxypropyl hexadecanoate.
Chemical Property Profile of 1,3-Propanediol dipalmitate
Property Insights of 1,3-Propanediol dipalmitate
The XLogP value of 15.0 indicates that 1,3-Propanediol dipalmitate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, 1,3-Propanediol dipalmitate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Propanediol dipalmitate has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,3-Propanediol dipalmitate?
The CAS number of 1,3-Propanediol dipalmitate is 818-21-3.
What is the molecular formula of 1,3-Propanediol dipalmitate?
The molecular formula of 1,3-Propanediol dipalmitate is C35H68O4.
What is the molecular weight of 1,3-Propanediol dipalmitate?
The molecular weight of 1,3-Propanediol dipalmitate is 552.51 g/mol.
Where can I buy 1,3-Propanediol dipalmitate?
You can request a quote for 1,3-Propanediol dipalmitate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Propanediol dipalmitate?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Propanediol dipalmitate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.